General Information of the Compound
| Compound ID |
CP0490476
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| Compound Name |
1-(4-chlorophenyl)-3-[2-(4-pyrrolidin-1-ylphenyl)ethyl]urea
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| Formula |
C19H22ClN3O
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| Molecular Weight |
343.858
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| Canonical SMILES |
Clc1ccc(NC(=O)NCCc2ccc(cc2)N2CCCC2)cc1
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| InChI |
InChI=1S/C19H22ClN3O/c20-16-5-7-17(8-6-16)22-19(24)21-12-11-15-3-9-18(10-4-15)23-13-1-2-14-23/h3-10H,1-2,11-14H2,(H2,21,22,24)
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| InChIKey |
PIIDREBWSVCRAE-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2